Geometry & MOs

Info

ID:	446221
PubChem CID:	135273241
Reduced:	NSO4C13H17 (1)
Stoich.:	ABC4D13E17 (1)
Weight, g/mol:	359.1333
ΔH_f, kcal/mol:	-151.35
Dipole, Da:	6.07
IP(EA), eV:	-9.79(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-difluorophenyl)-5-hexoxyisoindole-1,3-dione

Drug info:

PubChemData

Smile

CCCCCCOC1=CC2=C(C=C1)C(=O)NS2(=O)=O

DOS

IR

Vibrations